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Information card for entry 2240147
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| Coordinates | 2240147.cif |
|---|---|
| Structure factors | 2240147.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>trans</i>-Aqua(perchlorato-κ<i>O</i>)bis(propane-1,3-diamine-κ^2^<i>N</i>,<i>N</i>')copper(II) perchlorate |
|---|---|
| Formula | C6 H22 Cl2 Cu N4 O9 |
| Calculated formula | C6 H22 Cl2 Cu N4 O9 |
| Title of publication | Crystal structure of <i>trans</i>-aqua(perchlorato-κ<i>O</i>)bis(propane-1,3-diamine-κ^2^<i>N</i>,<i>N</i>')copper(II) perchlorate |
| Authors of publication | Govindaraj, J.; Rajkumar, K.; Ganeshraja, A. S.; Anbalagan, K.; SubbiahPandi, A. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2014 |
| Journal volume | 70 |
| Journal issue | 11 |
| Pages of publication | 438 - 440 |
| a | 7.8563 ± 0.0004 Å |
| b | 14.2936 ± 0.0006 Å |
| c | 14.8769 ± 0.0007 Å |
| α | 90° |
| β | 100.022 ± 0.005° |
| γ | 90° |
| Cell volume | 1645.11 ± 0.14 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0596 |
| Residual factor for significantly intense reflections | 0.0463 |
| Weighted residual factors for significantly intense reflections | 0.1162 |
| Weighted residual factors for all reflections included in the refinement | 0.1265 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181901 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/01 |
2240147.cif 2240147.hkl |
| 181321 | 2016-04-03 | hkl/2/24/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/24/01. |
2240147.cif 2240147.hkl |
| 176809 | 2016-02-21 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 2. |
2240147.cif 2240147.hkl |
| 126113 | 2014-11-01 | cif/ hkl/ Adding structures of 2240147 via cif-deposit CGI script. |
2240147.cif 2240147.hkl |
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Users of the data should acknowledge the original authors of the
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